Information card for entry 7714807

Structure parameters

• Formula: C248 H427 Br8 Cl20 N16 Ni24 O80.5
• Calculated formula: C184 H280 Br8 N16 Ni24 O80
• Title of publication: Tetracosanuclear nickel complexes as effective catalysts for cycloaddition of carbon dioxide with epoxides.
• Authors of publication: Liu, Guan-Lin; Wu, En-Hsu; Hung, Yu-Ching; Chou, Wei-Chi; Hung, Chia-Hsin; Lin, Chu-Chieh; Ko, Bao-Tsan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 4
• Pages of publication: 1425 - 1429
• a: 33.816 ± 0.004 Å
• b: 26.775 ± 0.004 Å
• c: 36.089 ± 0.005 Å
• α: 90°
• β: 90.081 ± 0.007°
• γ: 90°
• Cell volume: 32676 ± 8 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1667
• Residual factor for significantly intense reflections: 0.0875
• Weighted residual factors for significantly intense reflections: 0.2525
• Weighted residual factors for all reflections included in the refinement: 0.298
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No